4-[[2-(5-chloranyl-1-benzothiophen-3-yl)ethanoyl-(4-cyclohexylphenyl)amino]methyl]-N-(2H-1,2,3,4-tetrazol-5-yl)benzamide

Systemtic Name: 4-[[2-(5-chloranyl-1-benzothiophen-3-yl)ethanoyl-(4-cyclohexylphenyl)amino]methyl]-N-(2H-1,2,3,4-tetrazol-5-yl)benzamide Openeye Name: 4-[(N-[2-(5-chlorobenzothiophen-3-yl)acetyl]-4-cyclohexyl-anilino)methyl]-N-(2H-tetrazol-5-yl)benzamide CAS Name: 4-[(N-[2-(5-chloro-1-benzothiophen-3-yl)-1-oxoethyl]-4-cyclohexylanilino)methyl]-N-(2H-tetrazol-5-yl)benzamide IUPAC Name: 4-[(N-[2-(5-chloro-1-benzothiophen-3-yl)acetyl]-4-cyclohexylanilino)methyl]-N-(2H-tetrazol-5-yl)benzamide Traditional Name: 4-[(N-[2-(5-chlorobenzothiophen-3-yl)acetyl]-4-cyclohexyl-anilino)methyl]-N-(2H-tetrazol-5-yl)benzamide Formula: C31H29ClN6O2S MolecularWeight: 585.11896

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)N(CC3=CC=C(C=C3)C(=O)NC4=NNN=N4)C(=O)CC5=CSC6=C5C=C(C=C6)Cl

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)N(CC3=CC=C(C=C3)C(=O)NC4=NNN=N4)C(=O)CC5=CSC6=C5C=C(C=C6)Cl

InChI

InChI=1S/C31H29ClN6O2S/c32-25-12-15-28-27(17-25)24(19-41-28)16-29(39)38(26-13-10-22(11-14-26)21-4-2-1-3-5-21)18-20-6-8-23(9-7-20)30(40)33-31-34-36-37-35-31/h6-15,17,19,21H,1-5,16,18H2,(H2,33,34,35,36,37,40)